ASE database

Displaying rows 501-8 out of 8

↓ ID ✕	Formula ✕	Maximum stress ✕	str_E ✕	Age ✕	Calculator ✕	Maximum force ✕	Charge ✕	Username ✕	PBC ✕	atom_E ✕
501	Cu₇₂P	0.009	-258.140	15M	vasp	0.007	0.000	hecc	TTT	-1.888
502	Cu₇₂S	0.008	-257.602	15M	vasp	0.005	0.000	hecc	TTT	-0.945
503	Cu₇₂Cl	0.009	-255.817	15M	vasp	0.009	0.000	hecc	TTT	-0.243
504	Cu₇₂Ar	0.009	-252.163	15M	vasp	0.011	0.000	hecc	TTT	-0.025
505	Cu₇₂H	0.009	-255.116	15M	vasp	0.006	0.000	hecc	TTT	-1.117
506	Cu₇₂He	0.010	-252.122	15M	vasp	0.009	0.000	hecc	TTT	0.002
507	Cu₇₂Li	0.010	-254.178	15M	vasp	0.004	0.000	hecc	TTT	-0.299
508	BeCu₇₂	0.009	-253.474	15M	vasp	0.013	0.000	hecc	TTT	-0.039
509	Cu₇₂B	0.010	-255.137	15M	vasp	0.008	0.000	hecc	TTT	-0.349
510	Cu₇₂C	0.010	-256.266	15M	vasp	0.010	0.000	hecc	TTT	-1.248
511	Cu₇₂N	0.010	-256.842	15M	vasp	0.009	0.000	hecc	TTT	-3.124
512	Cu₇₂O	0.009	-257.085	15M	vasp	0.007	0.000	hecc	TTT	-1.533
513	Cu₇₂F	0.009	-256.591	15M	vasp	0.010	0.000	hecc	TTT	-0.424
514	Cu₇₂Ne	0.010	-252.138	15M	vasp	0.007	0.000	hecc	TTT	-0.013
515	Cu₇₂Na	0.010	-253.859	15M	vasp	0.009	0.000	hecc	TTT	-0.225
516	Cu₇₂Mg	0.009	-253.063	15M	vasp	0.006	0.000	hecc	TTT	-0.004
517	AlCu₇₂	0.010	-254.732	15M	vasp	0.010	0.000	hecc	TTT	-0.295
518	Cu₇₂Si	0.010	-255.804	15M	vasp	0.013	0.000	hecc	TTT	-0.830
519	Cu₇₂P	0.010	-256.307	15M	vasp	0.008	0.000	hecc	TTT	-1.888
520	Cu₇₂S	0.009	-256.293	15M	vasp	0.009	0.000	hecc	TTT	-0.945
521	Cu₇₂Cl	0.009	-255.574	15M	vasp	0.006	0.000	hecc	TTT	-0.243
522	Cu₇₂Ar	0.010	-252.148	15M	vasp	0.008	0.000	hecc	TTT	-0.025
523	Cu₅₄H	0.007	-196.524	15M	vasp	0.005	0.000	hecc	TTT	-1.120
524	Cu₅₄He	0.007	-192.846	15M	vasp	0.010	0.000	hecc	TTT	0.002
525	Cu₅₄Li	0.008	-195.478	15M	vasp	0.006	0.000	hecc	TTT	-0.299